[6-chloranyl-2-oxidanylidene-1-(phenylmethyl)-4-(4-thiophen-2-ylcarbonylpiperazin-1-yl)quinolin-3-yl]-methyl-oxidanylidene-azanium

Systemtic Name: [6-chloranyl-2-oxidanylidene-1-(phenylmethyl)-4-(4-thiophen-2-ylcarbonylpiperazin-1-yl)quinolin-3-yl]-methyl-oxidanylidene-azanium Openeye Name: [1-benzyl-6-chloro-2-oxo-4-[4-(thiophene-2-carbonyl)piperazin-1-yl]-3-quinolyl]-methyl-oxo-ammonium CAS Name: [6-chloro-2-oxo-4-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]-1-(phenylmethyl)-3-quinolinyl]-methyl-oxoammonium IUPAC Name: [1-benzyl-6-chloro-2-oxo-4-[4-(thiophene-2-carbonyl)piperazin-1-yl]quinolin-3-yl]-methyl-oxoazanium Traditional Name: [1-benzyl-6-chloro-2-keto-4-[4-(2-thenoyl)piperazino]-3-quinolyl]-keto-methyl-ammonium Formula: C26H24ClN4O3S+ MolecularWeight: 508.01176

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](=O)C1=C(C2=C(C=CC(=C2)Cl)N(C1=O)CC3=CC=CC=C3)N4CCN(CC4)C(=O)C5=CC=CS5

Isomeric SMILES

C[N+](=O)C1=C(C2=C(C=CC(=C2)Cl)N(C1=O)CC3=CC=CC=C3)N4CCN(CC4)C(=O)C5=CC=CS5

InChI

InChI=1S/C26H24ClN4O3S/c1-28(34)24-23(29-11-13-30(14-12-29)25(32)22-8-5-15-35-22)20-16-19(27)9-10-21(20)31(26(24)33)17-18-6-3-2-4-7-18/h2-10,15-16H,11-14,17H2,1H3/q+1